N-cyclopropyl-2-[4-(4-iodophenyl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-(4-iodophenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-(4-iodobenzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[(4-iodophenyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-(4-iodobenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-(4-iodobenzoyl)piperazin-1-ium-1-yl]acetamide Formula: C16H21IN3O2+ MolecularWeight: 414.26131

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C16H20IN3O2/c17-13-3-1-12(2-4-13)16(22)20-9-7-19(8-10-20)11-15(21)18-14-5-6-14/h1-4,14H,5-11H2,(H,18,21)/p+1